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Chemical Entities of Biological Interest Ontology
Last uploaded:
December 1, 2024
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| Preferred Name | cyproterone | |
| Synonyms |
Ciproterone cyproteronum ciproterona cyproterone 6-Chlor-delta(6)-1,2-alpha-methylen-17-alpha-hydroxyprogesteron 6-chloro-17-hydroxy-1beta,2beta-dihydro-3'H-cyclopropa[1,2]pregna-4,6-diene-3,20-dione |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_50742 |
|
| charge |
0
|
|
| database_cross_reference |
DrugBank:DB04839 Beilstein:4208522 Patent:DE1189991 Patent:US3234093 CAS:2098-66-0
|
|
| formula |
C22H27ClO3
|
|
| has parent hydride | ||
| has role | ||
| has_exact_synonym |
6-chloro-17-hydroxy-1beta,2beta-dihydro-3'H-cyclopropa[1,2]pregna-4,6-diene-3,20-dione
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
Ciproterone cyproteronum ciproterona cyproterone 6-Chlor-delta(6)-1,2-alpha-methylen-17-alpha-hydroxyprogesteron
|
|
| id |
CHEBI:50742
|
|
| in_subset | ||
| inchi |
InChI=1S/C22H27ClO3/c1-11(24)22(26)7-5-14-12-9-18(23)17-10-19(25)13-8-16(13)21(17,3)15(12)4-6-20(14,22)2/h9-10,12-16,26H,4-8H2,1-3H3/t12-,13+,14-,15-,16-,20-,21-,22-/m0/s1
|
|
| inchikey |
DUSHUSLJJMDGTE-ZJPMUUANSA-N
|
|
| label |
cyproterone
|
|
| mass |
374.90068
|
|
| monoisotopicmass |
374.16487
|
|
| notation |
CHEBI:50742
|
|
| prefLabel |
cyproterone
|
|
| smiles |
[H][C@@]12C[C@]1([H])[C@@]1(C)C(=CC2=O)C(Cl)=C[C@@]2([H])[C@]3([H])CC[C@](O)(C(C)=O)[C@@]3(C)CC[C@]12[H]
|
|
| treeView |
http://purl.obolibrary.org/obo/CHEBI_139592 http://purl.obolibrary.org/obo/CHEBI_77175 http://purl.obolibrary.org/obo/CHEBI_36885 |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_139592 http://purl.obolibrary.org/obo/CHEBI_77175 http://purl.obolibrary.org/obo/CHEBI_36885 |
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